Vitas-M small molecule compound
(6Z)-2-butyl-6-{[2,5-dimethyl-1-(naphthalen-1-yl)-1H-pyrrol-3-yl]methylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224165
SMILES CCCCc1nn2c(=NC(=O)/C(=C\c3cc(n(c3C)c3cccc4c3cccc4)C)/C2=N)s1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H25N5OS MW 455.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5OS/c1-4-5-13-23-29-31-24(27)21(25(32)28-26(31)33-23)15-19-14-16(2)30(17(19)3)22-12-8-10-18-9-6-7-11-20(18)22/h6-12,14-15,27H,4-5,13H2,1-3H3/b21-15-,27-24-InChIKey
LEUQNJVKJJAWQQ-ZLBPUWNPSA-NSynonyms
844858-87-3(6Z)2butyl6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)2butyl6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylene)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
844858873
CCCCc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3cccc4c3cccc4)C)C2=N)s1
MFCD04165199
ZINC000009281168
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